CHEMBRIDGE-ZINC02810297 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 52 0 0 0 0 0 0 0 0999 V2000 -0.1090 1.5420 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 0.0140 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 -0.4670 1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2790 -0.2870 1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7530 -1.0380 -0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0450 -0.5840 -1.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 -1.6060 -2.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5170 0.7900 -1.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9890 -0.7660 2.2700 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2480 -0.3150 2.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9170 0.5090 1.9940 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8110 -0.9510 3.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1410 -1.7850 4.4630 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0610 -0.4950 4.2020 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7680 -0.9720 5.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0870 -0.2670 5.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1610 0.9650 6.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3770 1.6440 6.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5240 1.0950 5.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4660 -0.1240 5.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2490 -0.8020 4.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0230 1.9340 5.8350 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.4810 -0.5240 0.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 2.0210 0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 1.8590 -0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 1.9550 0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 0.0620 2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -1.5300 1.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5180 0.7770 1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8390 -0.9220 -0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5890 -2.1140 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9520 -2.6080 -2.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7840 -1.3200 -3.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3700 -1.6820 -2.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5500 0.7330 -2.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8990 1.1550 -2.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5140 1.5490 -1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5800 -1.4680 2.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4870 0.2030 3.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1380 -0.8140 6.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9080 -2.0540 5.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2680 1.4060 6.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4190 2.5970 6.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3580 -0.5500 4.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2130 -1.7490 4.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 -0.2170 -0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5010 -1.6190 0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9810 -0.1500 1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5480 -0.5720 -1.2010 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2300 -1.5510 -1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -0.1240 -2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 49 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 49 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 49 50 1 0 0 0 0 49 51 1 0 0 0 0 M CHG 1 49 1 M END